SCHEMBL4397314

SCHEMBL4397314

Cc1cc(=O)oc2cc(OC(=O)Nc3ccc(F)c(Cl)c3)ccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.56
ALDH1A1 P00352 6/20 0.56
NPC1 O15118 6/20 0.56
RAB9A P51151 6/20 0.56
HPGD P15428 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
HSD17B10 Q99714 2/20 0.56
GLA P06280 3/20 0.56
GAA P10253 3/20 0.56
CA9 Q16790 7/20 0.55
CA12 O43570 6/20 0.55
CA1 P00915 4/20 0.55
CTDSP1 Q9GZU7 3/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
KMT2A Q03164 3/20 0.52
POLB P06746 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4381248 0.84 KMT2A (0.53) KDM4EALDH1A1NPC1RAB9AHPGD
SCHEMBL4386624 0.76 KDM4E (0.55) KDM4EALDH1A1NPC1RAB9AHPGD
SCHEMBL119578 0.76 RAB9A (0.78) KDM4EALDH1A1NPC1RAB9AHPGD
SCHEMBL18917474 0.74 ALDH1A1 (0.76) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL4379921 0.74 ALPL (0.52) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL15252563 0.74 DGAT1 (0.57) KDM4EALDH1A1NPC1RAB9AHPGD
SCHEMBL335474 0.73 KDM4E (1.00) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL29651337 0.73 KDM4E (1.00) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL12987100 0.73 ALDH1A1 (1.00) KDM4EALDH1A1NPC1RAB9AHPGD
SCHEMBL4385143 0.72 KDM4E (0.63) KDM4EALDH1A1NPC1RAB9AHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed